N-methyl-N-(2-methyl-4-oxo-2-phenylbutyl)Benzenesulfonamide

Base Information

• Chemical Name: N-methyl-N-(2-methyl-4-oxo-2-phenylbutyl)Benzenesulfonamide
• CAS No.: 209350-34-5
• Molecular Formula: C18H21NO3S
• Molecular Weight: 331.436
• DSSTox Substance ID: DTXSID60573164

Synonyms:209350-34-5;N-methyl-N-(2-methyl-4-oxo-2-phenylbutyl)Benzenesulfonamide;SCHEMBL7644093;DTXSID60573164

Chemical Property of N-methyl-N-(2-methyl-4-oxo-2-phenylbutyl)Benzenesulfonamide

Chemical Property:

• XLogP3: 2.8
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 331.12421471
• Heavy Atom Count: 23
• Complexity: 473

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(CC=O)(CN(C)S(=O)(=O)C1=CC=CC=C1)C2=CC=CC=C2

Technology Process of N-methyl-N-(2-methyl-4-oxo-2-phenylbutyl)Benzenesulfonamide

There total 2 articles about N-methyl-N-(2-methyl-4-oxo-2-phenylbutyl)Benzenesulfonamide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

(R,S)-N-methyl-N-(2,5-dimethyl-2-phenylhex-4-en-1-yl)benzenesulfonamide (209350-33-4) + sodium hydrogensulfite + 4-methylmorpholine N-oxide (7529-22-8) → N-Methyl-N-(2-methyl-2-phenyl-4-oxobut-1-yl)benzenesulfonamide (209350-34-5)

Guidance literature:

With sodium periodate; osmium(VIII) oxide; In tetrahydrofuran; hexane; water; acetone; tert-butyl alcohol;

Reference yield:

(R,S)-N-methyl-N-(2,5-dimethyl-2-phenylhex-4-en-1-yl)benzenesulfonamide (209350-33-4) + 4-methylmorpholine N-oxide (7529-22-8) → N-Methyl-N-(2-methyl-2-phenyl-4-oxobut-1-yl)benzenesulfonamide (209350-34-5)

Guidance literature:

With sodium periodate; osmium(VIII) oxide; In tetrahydrofuran; water; ethyl acetate; acetone; tert-butyl alcohol;

Reference yield:

N-Methyl-N-(2-methyl-2-phenyl-4-oxobut-1-yl)benzenesulfonamide (209350-34-5) + spiro[2,3-dihydrobenzothiophene]-3,4'-piperidine hydrochloride → N-Methyl-N-(2-methyl-2-phenyl-4-(spiro(benzo[b]thiophene-3(2H),4'-piperidin)-1'-yl)butyl)benzenesulfonamide hydrochloride (209349-56-4)

Guidance literature:

With sodium tris(acetoxy)borohydride; N-ethyl-N,N-diisopropylamine; In tetrahydrofuran; dichloromethane; ethyl acetate;

upstream raw materials:

(R,S)-N-methyl-N-(2,5-dimethyl-2-phenylhex-4-en-1-yl)benzenesulfonamide

4-methylmorpholine N-oxide

Downstream raw materials:

N-Methyl-N-(2-methyl-2-phenyl-4-(spiro(benzo[b]thiophene-3(2H),4'-piperidin)-1'-yl)butyl)benzenesulfonamide hydrochloride

(R,S)-N-Methyl-N-[2-methyl-2-phenyl-4-(4-phenylpiperidin-1-yl)but-1-yl]benzenesulfonamide hydrochloride

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